Non covalent interactions and molecular docking studies on morphine compound
The (5α,6α)-7,8-didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol (morphine)molecule has been studied using the density functional theory and molecular docking methods and non covalent interactions. The conformational analysis of the molecule at the B3LYP/6−311++G** and HF/6−311++G** levels has been m...
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Autores principales: | Abir Sagaama, Noureddine Issaoui, Omar Al-Dossary, Aleksandr S. Kazachenko, Marek.J. Wojcik |
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Formato: | article |
Lenguaje: | EN |
Publicado: |
Elsevier
2021
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Materias: | |
Acceso en línea: | https://doaj.org/article/de049294217a4bfc8af83a78293c3b95 |
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